CLASSICAL AND QUANTUM CONTINUUM PERCOLATION WITH HARD-CORE INTERACTIONS

被引:13
作者
SAVEN, JG
SKINNER, JL
WRIGHT, JR
机构
[1] UNIV WISCONSIN,DEPT CHEM,MADISON,WI 53706
[2] COLUMBIA UNIV,DEPT CHEM,NEW YORK,NY 10027
关键词
D O I
10.1063/1.460401
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
We study the classical and quantum percolation of spheres in a three-dimensional continuum. Each sphere has an impenetrable hard core of diameter sigma, and two spheres are considered to be directly connected if the distance between their centers is less than d. We calculate the critical percolation density as a function of sigma/d. In the classical problem this is the density rho-c at which an infinite cluster of connected spheres first forms. In the quantum problem, we study a tight-binding model where the hopping matrix element between two spheres is nonzero only if they are directly connected. In this case the critical density rho-q is the density at which the eigenstates of the Hamiltonian first become extended. Our method uses Monte Carlo simulation and finite-size scaling techniques, and for the quantum problem, the concept of quantum connectivity. We find that both rho-c and rho-q exhibit nonmonotonic behavior as a function of sigma/d. We also find that for all values of sigma/d, rho-q > rho-c, although the ratio of the thresholds decreases with increasing sigma/d. We argue that a better understanding of this ratio is obtained by considering the average coordination number. We speculate about the nature of both classical and quantum percolation as sigma/d approaches 1.
引用
收藏
页码:6153 / 6159
页数:7
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